4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-3,5-dimethyl-isoxazole CAS Name: 4-[[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]sulfonyl]-3,5-dimethylisoxazole IUPAC Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]sulfonyl-3,5-dimethyl-isoxazole Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC[C@@H]2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H22N2O5S/c1-12-18(13(2)25-19-12)26(21,22)20-8-3-5-15(20)14-6-7-16-17(11-14)24-10-4-9-23-16/h6-7,11,15H,3-5,8-10H2,1-2H3/t15-/m1/s1